Basic information
- Standard SMILES
Cl.Oc1ccc2[nH]c3c(c2c1)CCNC3C(F)(F)F- InChIKey
WJWKRKCDOARGBJ-UHFFFAOYSA-N- Molecular formula
- C12H12ClF3N2O
- Average molar mass
- 292.68 g/mol
Names & identifiers
- Preferred name
- 1-trifluoromethyl-2,3,4,9-tetrahydro-1H-beta-carbolin-6-ol hydrochloride
- IUPAC
- 1-(trifluoromethyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-6-ol;hydrochloride
Names & synonyms
1-trifluoromethyl-2,3,4,9-tetrahydro-1H-beta-carbolin-6-ol hydrochlorideSCHEMBL5682326
Database identifiers
- PubChem CID
- 22018500
Properties
Computed structural properties
- Topological polar surface area
- 48.1 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 323
Related reactions
1 records
Compound notes
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